AB/AB4_tI10_87_a_h.AB params=6.0865073630801065,0.3982037454876223,0.9187335490661802,0.712897059584082 SG=87 [ANRL doi: 10.1016/j.commatsci.2017.01.017 (part 1), doi: 10.1016/j.commatsci.2018.10.043 (part 2)]
1.000000
  -3.04325368154005   3.04325368154005   1.21183501445824
   3.04325368154005  -3.04325368154005   1.21183501445824
   3.04325368154005   3.04325368154005  -1.21183501445824
C Fe
1 4 
Direct(5) [A1B4] 
   0.00000000000000   0.00000000000000   0.00000000000000  A     
   0.71289705958408   0.91873354906618   0.63163060865026  B     
   0.28710294041592   0.08126645093382   0.36836939134974  B     
   0.91873354906618   0.28710294041592   0.20583648948210  B     
   0.08126645093382   0.71289705958408   0.79416351051790  B